2,6-Dimethyl-β-oxobenzenepropanenitrile

CAS Registry Number®

677713-07-4
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CAS Name

2,6-Dimethyl-β-oxobenzenepropanenitrile

Molecular Formula

C11H11NO

Molecular Mass

173.21

Cite this Page

2,6-Dimethyl-β-oxobenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=677713-07-4 (retrieved 2024-07-06) (CAS RN: 677713-07-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H11NO/c1-8-4-3-5-9(2)11(8)10(13)6-7-12/h3-5H,6H2,1-2H3

InChIKey

InChIKey=ZRGDABNLAQETGR-UHFFFAOYSA-N

SMILES

C(CC#N)(=O)C1=C(C)C=CC=C1C

Canonical SMILES

N#CCC(=O)C=1C(=CC=CC1C)C

Other Names for this Substance

  • Benzenepropanenitrile, 2,6-dimethyl-β-oxo-
  • 2,6-Dimethyl-β-oxobenzenepropanenitrile
  • 3-(2,6-Dimethylphenyl)-3-oxopropionitrile
  • 2,6-Dimethylbenzoylacetonitrile